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Entry Data

Table mix-ins: ['Structure'] Extra columns: ['energy_above_hull']

Base Information:

  • Database Entry ID: jvasp-44145
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 12
  • Number of elements: 3
  • Element list: ['Fe', 'O', 'F']
  • Chemical System: F-Fe-O
  • Density: 5.398436606568951
  • Atomic Density: 0.11008751149388328
  • Unit Cell Volume: 109.00418982280972
  • Molar Volume: 5.470321454522663
  • Full Formula: Fe4 O7 F1
  • Reduced Formula: Fe4O7F
  • Formula Anonymous: AB4C7
  • Spacegroup Number: 38
  • Spacegroup Symbol: Amm2
  • Crystal System: orthorhombic
  • Pointgroup: mm2